M023-0439 Screening compound: N-(3-acetylphenyl)-4-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide

M023-0439 Screening compound: N-(3-acetylphenyl)-4-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide
M023-0439 Screening compound: N-(3-acetylphenyl)-4-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide alternative view

Chemical Structure Depiction of ChemDiv screening compound M023-0439
N-(3-acetylphenyl)-4-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

M023-0439

Molecular Formula

C22H23N3O4S3 (C22 H23 N3 O4 S3)

Compound Name

N-(3-acetylphenyl)-4-[4-methyl-5-(piperidine-1-carbonyl)-1,3-thiazol-2-yl]thiophene-2-sulfonamide

IUPAC name

N-(3-acetylphenyl)-4-[4-methyl-5-(piperidine-1-carbonyl)-13-thiazol-2-yl]thiophene-2-sulfonamide

SMILES

CC(c1cccc(NS(c2cc(-c3nc(C)c(C(N4CCCCC4)=O)s3)cs2)(=O)=O)c1)=O

InChI

InChI=1S/C22H23N3O4S3/c1-14-20(22(27)25-9-4-3-5-10-25)31-21(23-14)17-12-19(30-13-17)32(28,29)24-18-8-6-7-16(11-18)15(2)26/h6-8,11-13,24H,3-5,9-10H2,1-2H3

InChI Key

KAZXSEKKMOWKND-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD27493342

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

489.64

Hydrogen Bond Acceptors Count

9.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

7.00

Number of Nitrogen and Oxygen Atoms

7

Partition Coefficient, logP

4.241

Distribution Coefficient, logD

4.146

Water Solubility, LogSw

-4.19

Polar Surface Area

82.692

Acid Dissociation Constant (pKa)

8.01

Base Dissociation Constant (pKb)

2.27

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

31.80

M023-0439 in Drug Discovery

Included in Screening Libraries

300k Representative Compounds Library (Bemis-Murcko Clustering Algorithm) (286253 compounds)

Lipid Metabolism Library (9174 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Cardiovascular
  • Metabolic

References: we are preparing a list of scientific research reports with M023-0439 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound M023-0439?
Check Price and Availability of M023-0439, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of M023-0439 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for M023-0439
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for M023-0439
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of M023-0439 available by request